NDLI: The electronic structure of antiferromagnetic chromium

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The electronic structure of antiferromagnetic chromium

Content Provider	Scilit
Author	Skriver, H. L.
Copyright Year	1981
Description	Journal: Journal of Physics F: Metal Physics The author has used the local spin density formalism to perform self-consistent calculations of the electronic structure of chromium in the non-magnetic and commensurate antiferromagnetic phases, as a function of the lattice parameter. A change of a few per cent in the atomic radius brings the calculated ground state properties into agreement with experiment. The magnetisation is studied as function of volume in several models, and it is shown that a Stoner picture provides an extremely accurate description of the full calculation provided the sp-d hybridisation is taken into account. It is found that the calculated sublattice magnetisation is extremely sensitive to the exchange-correlation potential used and to the quality of the calculated state density.
Related Links	http://iopscience.iop.org/article/10.1088/0305-4608/11/1/013/pdf
ISSN	03054608
DOI	10.1088/0305-4608/11/1/013
Journal	Journal of Physics F: Metal Physics
Issue Number	1
Volume Number	11
Language	English
Publisher	IOP Publishing
Publisher Date	1981-01-01
Access Restriction	Open
Subject Keyword	Journal: Journal of Physics F: Metal Physics Condensed Matter Physics Lattice Parameter Ground State Electronic Structure
Content Type	Text
Resource Type	Article
Subject	Metals and Alloys 3100/3101 Engineering

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